3-[[(4-methoxyphenyl)-(thiophen-2-ylmethyl)carbamothioyl]amino]propyl-dimethyl-azanium

Systemtic Name: 3-[[(4-methoxyphenyl)-(thiophen-2-ylmethyl)carbamothioyl]amino]propyl-dimethyl-azanium Openeye Name: 3-[[(4-methoxyphenyl)-(2-thienylmethyl)carbamothioyl]amino]propyl-dimethyl-ammonium CAS Name: 3-[[[4-methoxy-N-(thiophen-2-ylmethyl)anilino]-sulfanylidenemethyl]amino]propyl-dimethylammonium IUPAC Name: 3-[[(4-methoxyphenyl)-(thiophen-2-ylmethyl)carbamothioyl]amino]propyl-dimethylazanium Traditional Name: 3-[[(4-methoxyphenyl)-(2-thenyl)thiocarbamoyl]amino]propyl-dimethyl-ammonium Formula: C18H26N3OS2+ MolecularWeight: 364.54854

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCNC(=S)N(CC1=CC=CS1)C2=CC=C(C=C2)OC

Isomeric SMILES

C[NH+](C)CCCNC(=S)N(CC1=CC=CS1)C2=CC=C(C=C2)OC

InChI

InChI=1S/C18H25N3OS2/c1-20(2)12-5-11-19-18(23)21(14-17-6-4-13-24-17)15-7-9-16(22-3)10-8-15/h4,6-10,13H,5,11-12,14H2,1-3H3,(H,19,23)/p+1